Geometry & MOs

Info

ID:	121228
PubChem CID:	50759407
Reduced:	ClFN2O2H16C23 (1)
Stoich.:	ABC2D2E16F23 (1)
Weight, g/mol:	402.137971
ΔH_f, kcal/mol:	-38.36
Dipole, Da:	6.8
IP(EA), eV:	-9.46(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-fluorophenyl)methyl]-3-(2-methoxybenzoyl)-7-methyl-1,8-naphthyridin-4-one

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C(=O)C(=CN2CC3=CC=CC=C3F)C(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations